4-(2,2-diethoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2,2-diethoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,2-diethoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-(2,2-diethoxyethyl)-1H-1,2,4-triazole-5-thione Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C(=NNC1=S)CC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC(CN1C(=NNC1=S)CC2=CC=CC=C2)OCC

InChI

InChI=1S/C15H21N3O2S/c1-3-19-14(20-4-2)11-18-13(16-17-15(18)21)10-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3,(H,17,21)